2-butyl-4,7-dimethyl-6-prop-2-enyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2-butyl-4,7-dimethyl-6-prop-2-enyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-allyl-2-butyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 2-butyl-4,7-dimethyl-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-butyl-4,7-dimethyl-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-allyl-2-butyl-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C3N2C=C(N3CC=C)C)N(C1=O)C

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C3N2C=C(N3CC=C)C)N(C1=O)C

InChI

InChI=1S/C16H21N5O2/c1-5-7-9-20-14(22)12-13(18(4)16(20)23)17-15-19(8-6-2)11(3)10-21(12)15/h6,10H,2,5,7-9H2,1,3-4H3